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(Q113959869)
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English
7-{[(1S,2R,6S,8aS)-6-hydroxy-2,5,5-trimethyl-2,3,6,7,8,8a-hexahydro-1H-naphthalen-1-yl]methoxy}chromen-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
368.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₈O₄
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canonical SMILES
O=C1OC=2C=C(OCC3C4C(=CCC3C)C(C)(C)C(O)CC4)C=CC2C=C1
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isomeric SMILES
C[C@@H]1CC=C2[C@@H](CC[C@H](O)C2(C)C)[C@H]1COc1ccc2ccc(=O)oc2c1
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found in taxon
Ferula sinkiangensis
1 reference
stated in
Sesquiterpene Coumarins from Ferula sinkiangensis Act as Neuroinflammation Inhibitors
Identifiers
InChI
InChI=1S/C23H28O4/c1-14-4-9-19-17(8-10-21(24)23(19,2)3)18(14)13-26-16-7-5-15-6-11-22(25)27-20(15)12-16/h5-7,9,11-12,14,17-18,21,24H,4,8,10,13H2,1-3H3/t14-,17+,18+,21+/m1/s1
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InChIKey
GXIWWCJSWARCNX-SIHWBGBFSA-N
0 references
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